[1-oxidanylidene-1-(7H-purin-6-ylamino)propan-2-yl] 3-methylfuran-2-carboxylate

Systemtic Name: [1-oxidanylidene-1-(7H-purin-6-ylamino)propan-2-yl] 3-methylfuran-2-carboxylate Openeye Name: [1-methyl-2-oxo-2-(7H-purin-6-ylamino)ethyl] 3-methylfuran-2-carboxylate CAS Name: 3-methyl-2-furancarboxylic acid [1-oxo-1-(7H-purin-6-ylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(7H-purin-6-ylamino)propan-2-yl] 3-methylfuran-2-carboxylate Traditional Name: 3-methylfuran-2-carboxylic acid [2-keto-1-methyl-2-(7H-purin-6-ylamino)ethyl] ester Formula: C14H13N5O4 MolecularWeight: 315.28412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC=C1)C(=O)OC(C)C(=O)NC2=NC=NC3=C2NC=N3

Isomeric SMILES

CC1=C(OC=C1)C(=O)OC(C)C(=O)NC2=NC=NC3=C2NC=N3

InChI

InChI=1S/C14H13N5O4/c1-7-3-4-22-10(7)14(21)23-8(2)13(20)19-12-9-11(16-5-15-9)17-6-18-12/h3-6,8H,1-2H3,(H2,15,16,17,18,19,20)